In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 5.05 | 10.29 | -36.13 | 2 | 2 | 1 | 26 | 270.396 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.05 | 9.15 | -3.59 | 1 | 2 | 0 | 21 | 269.388 | 6 | ↓ |